Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:34:55 UTC
Update Date2025-03-24 22:08:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02002374
Frequency0.6
Structure
Chemical FormulaC9H16O
Molecular Mass140.1201
SMILESCC1CC2C(CO1)C2(C)C
InChI KeyVECWYLIVOMNQLW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxepanes
Subclass oxepanes
Direct Parent oxepanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • oxanes
  • Substituents
  • aliphatic heteropolycyclic compound
  • oxepane
  • oxacycle
  • ether
  • organic oxygen compound
  • hydrocarbon derivative
  • oxane
  • dialkyl ether
  • organooxygen compound